[5-azanyl-2-oxidanyl-3-(phenylsulfonyloxy)phenyl] benzenesulfonate

Systemtic Name: [5-azanyl-2-oxidanyl-3-(phenylsulfonyloxy)phenyl] benzenesulfonate Openeye Name: [5-amino-3-(benzenesulfonyloxy)-2-hydroxy-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [5-amino-3-(benzenesulfonyloxy)-2-hydroxyphenyl] ester IUPAC Name: [5-amino-3-(benzenesulfonyloxy)-2-hydroxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid (5-amino-3-besyloxy-2-hydroxy-phenyl) ester Formula: C18H15NO7S2 MolecularWeight: 421.4442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC(=C2O)OS(=O)(=O)C3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC(=C2O)OS(=O)(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C18H15NO7S2/c19-13-11-16(25-27(21,22)14-7-3-1-4-8-14)18(20)17(12-13)26-28(23,24)15-9-5-2-6-10-15/h1-12,20H,19H2